2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide

C24H21NO5 — CID 70163906

IUPAC2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(C)=O)cc1.O=c1cc(-c2ccccc2O)oc2ccccc12
InChIInChI=1S/C15H10O3.C9H11NO2/c16-12-7-3-1-5-10(12)15-9-13(17)11-6-2-4-8-14(11)18-15;1-7(11)10-8-3-5-9(12-2)6-4-8/h1-9,16H;3-6H,1-2H3,(H,10,11)
InChIKeyDVUVZBVEIWEFLM-UHFFFAOYSA-N
MW403.43 g/mol
LogP4.82
Rot. Bonds3

About 2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide

2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide (PubChem CID 70163906) has the molecular formula C24H21NO5 and a molecular weight of 403.43 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide
PubChem CID70163906
Molecular FormulaC24H21NO5
Molecular Weight403.43 g/mol
Exact Mass403.14
IUPAC Name2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(C)=O)cc1.O=c1cc(-c2ccccc2O)oc2ccccc12
InChIInChI=1S/C15H10O3.C9H11NO2/c16-12-7-3-1-5-10(12)15-9-13(17)11-6-2-4-8-14(11)18-15;1-7(11)10-8-3-5-9(12-2)6-4-8/h1-9,16H;3-6H,1-2H3,(H,10,11)
InChIKeyDVUVZBVEIWEFLM-UHFFFAOYSA-N
XLogP4.82
TPSA88.77 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.43
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide (CID 70163906) is 2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide is COc1ccc(NC(C)=O)cc1.O=c1cc(-c2ccccc2O)oc2ccccc12.
What is the InChIKey of 2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide?
The InChIKey is DVUVZBVEIWEFLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10O3.C9H11NO2/c16-12-7-3-1-5-10(12)15-9-13(17)11-6-2-4-8-14(11)18-15;1-7(11)10-8-3-5-9(12-2)6-4-8/h1-9,16H;3-6H,1-2H3,(H,10,11).
What are the key properties of 2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide?
2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide has a molecular weight of 403.43 g/mol, XLogP of 4.82, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)chromen-4-one;N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 70163906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).